Home Aldehydes 3,4-Dimethylbenzaldehyde

3,4-Dimethylbenzaldehyde

CAS No.:
5973-71-7
Catalog Number:
AG003IIJ
Molecular Formula:
C9H10O
Molecular Weight:
134.1751
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
95%
In Stock USA
United States
$13
- +
25g
95%
In Stock USA
United States
$25
- +
100g
95%
In Stock USA
United States
$63
- +
500g
95%
In Stock USA
United States
$188
- +
Product Description
Catalog Number:
AG003IIJ
Chemical Name:
3,4-Dimethylbenzaldehyde
CAS Number:
5973-71-7
Molecular Formula:
C9H10O
Molecular Weight:
134.1751
MDL Number:
MFCD00016612
IUPAC Name:
3,4-dimethylbenzaldehyde
InChI:
InChI=1S/C9H10O/c1-7-3-4-9(6-10)5-8(7)2/h3-6H,1-2H3
InChI Key:
POQJHLBMLVTHAU-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(c(c1)C)C
EC Number:
227-770-2
UNII:
16G1J12ARB
Properties
Complexity:
120  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
134.073g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
134.178g/mol
Monoisotopic Mass:
134.073g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Literature
Title Journal
Screening of endocrine activity of compounds migrating from plastic baby bottles using a multi-receptor panel of in vitro bioassays. Toxicology in vitro : an international journal published in association with BIBRA 20161201
Crystallinity enhancement of Nafion electrolyte membranes assisted by a molecular gelator. Langmuir : the ACS journal of surfaces and colloids 20110802
(E)-1-(3,4-Dimethyl-benzyl-idene)-2,2-diphenyl-hydrazine. Acta crystallographica. Section E, Structure reports online 20110601
5-(3,4-Dimethyl-benzyl-idene)-2,2-dimethyl-1,3-dioxane-4,6-dione. Acta crystallographica. Section E, Structure reports online 20110601
1-(3,4-Dimethyl-benzyl-idene)-4-ethyl-thio-semicarbazide. Acta crystallographica. Section E, Structure reports online 20101001
1-(4-Chloro-phen-yl)-3-(3,4-dimethyl-phen-yl)prop-2-en-1-one. Acta crystallographica. Section E, Structure reports online 20100901
N'-(3,4-Dimethyl-benzyl-idene)furan-2-carbohydrazide. Acta crystallographica. Section E, Structure reports online 20100801
1-(4-Bromo-phen-yl)-3-(3,4-dimethyl-phen-yl)prop-2-en-1-one. Acta crystallographica. Section E, Structure reports online 20100601
Floral visitation and reproductive traits of Stamenoid petals, a naturally occurring floral homeotic variant of Capsella bursa-pastoris (Brassicaceae). Planta 20091101
Vibrational spectroscopy investigation using ab initio and density functional theory analysis on the structure of 3,4-dimethylbenzaldehyde. Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20071101
Chemical biotechnology for the specific oxyfunctionalization of hydrocarbons on a technical scale. Biotechnology and bioengineering 20030630
Use of the two-liquid phase concept to exploit kinetically controlled multistep biocatalysis. Biotechnology and bioengineering 20030320
Properties